10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline

C30H25NOSi — CID 59167350

IUPAC10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline
SMILESCOc1cc2c(cc1C)[Si](c1ccccc1)(c1ccccc1)c1cc(C)c3ncccc3c1-2
InChIInChI=1S/C30H25NOSi/c1-20-17-27-25(19-26(20)32-3)29-24-15-10-16-31-30(24)21(2)18-28(29)33(27,22-11-6-4-7-12-22)23-13-8-5-9-14-23/h4-19H,1-3H3
InChIKeyJXWALYCVPCAQRY-UHFFFAOYSA-N
MW443.62 g/mol
LogP4.22
Rot. Bonds3

About 10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline

10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline (PubChem CID 59167350) has the molecular formula C30H25NOSi and a molecular weight of 443.62 g/mol. Its IUPAC name is 10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline.

Molecular Properties

Compound Name10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline
PubChem CID59167350
Molecular FormulaC30H25NOSi
Molecular Weight443.62 g/mol
Exact Mass443.17
IUPAC Name10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline
SMILESCOc1cc2c(cc1C)[Si](c1ccccc1)(c1ccccc1)c1cc(C)c3ncccc3c1-2
InChIInChI=1S/C30H25NOSi/c1-20-17-27-25(19-26(20)32-3)29-24-15-10-16-31-30(24)21(2)18-28(29)33(27,22-11-6-4-7-12-22)23-13-8-5-9-14-23/h4-19H,1-3H3
InChIKeyJXWALYCVPCAQRY-UHFFFAOYSA-N
XLogP4.22
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.62
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline?
The IUPAC name of 10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline (CID 59167350) is 10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline.
What is the SMILES notation for 10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline?
The canonical SMILES for 10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline is COc1cc2c(cc1C)[Si](c1ccccc1)(c1ccccc1)c1cc(C)c3ncccc3c1-2.
What is the InChIKey of 10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline?
The InChIKey is JXWALYCVPCAQRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25NOSi/c1-20-17-27-25(19-26(20)32-3)29-24-15-10-16-31-30(24)21(2)18-28(29)33(27,22-11-6-4-7-12-22)23-13-8-5-9-14-23/h4-19H,1-3H3.
What are the key properties of 10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline?
10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline has a molecular weight of 443.62 g/mol, XLogP of 4.22, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methoxy-5,9-dimethyl-7,7-diphenyl-[1]benzosilolo[3,2-f]quinoline is sourced from PubChem (CID 59167350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).